SCHEMBL8475953

SCHEMBL8475953

CC(C1CCCN1)n1c(C(=O)NCCN2CCCCC2)c(C(c2ccccc2)c2ccccc2)c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.40
TSHR P16473 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
RAB9A P51151 1/20 0.40
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PARP1 P09874 1/20 0.38
PKM P14618 1/20 0.37
HTR4 Q13639 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
SLC6A3 Q01959 2/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8472210 0.88 KDM4E (0.43) KDM4ELMNATSHRALDH1A1HPGD
Hydrochloric Acid SCHEMBL8474176 0.88 SLC6A3 (0.39) LMNATSHRALDH1A1TDP1SLC6A3
SCHEMBL8476838 0.85 KDM4E (0.40) KDM4ELMNATSHRALDH1A1HPGD
Hydrochloric Acid SCHEMBL8476312 0.85 SLC6A3 (0.36) LMNATSHRALDH1A1TDP1SLC6A3
SCHEMBL8473691 0.84 SLC6A3 (0.43) LMNATSHRALDH1A1TDP1SLC6A3
SCHEMBL8472588 0.83 ALDH1A1 (0.43) KDM4ELMNATSHRMEN1ALDH1A1
SCHEMBL8472627 0.82 SLC6A3 (0.43) LMNATSHRALDH1A1TDP1SLC6A3
SCHEMBL8477355 0.82 GPR88 (0.38) LMNATSHRALDH1A1TDP1SLC6A3
SCHEMBL8475954 0.82 KDM4E (0.45) KDM4ELMNAMAPTTSHRMEN1
SCHEMBL8474450 0.81 LMNA (0.47) KDM4ELMNAMAPTALDH1A1HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5891902-A OSTEOPOROSIS KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-04-06 US disclosed
EP-0782989-A1 INDOLE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-07-09 EP disclosed